2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide

C17H19N3O — CID 60937842

IUPAC2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(CNc1ccccc1)N(Cc1cccnc1)C1CC1
InChIInChI=1S/C17H19N3O/c21-17(12-19-15-6-2-1-3-7-15)20(16-8-9-16)13-14-5-4-10-18-11-14/h1-7,10-11,16,19H,8-9,12-13H2
InChIKeyYXWQVNNSEVMFPD-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.68
Rot. Bonds6

About 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide

2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 60937842) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide
PubChem CID60937842
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(CNc1ccccc1)N(Cc1cccnc1)C1CC1
InChIInChI=1S/C17H19N3O/c21-17(12-19-15-6-2-1-3-7-15)20(16-8-9-16)13-14-5-4-10-18-11-14/h1-7,10-11,16,19H,8-9,12-13H2
InChIKeyYXWQVNNSEVMFPD-UHFFFAOYSA-N
XLogP2.68
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-benzyl-N-cyclopropylacetamide;hydrochloride
CID 119703213
N-cyclopropyl-2-(cyclopropylmethylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 54869938
N-cyclopropyl-2-(prop-2-enylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 79285110
2-anilino-N-cyclopropyl-N-[(4-fluorophenyl)methyl]acetamide
CID 119693145
4-amino-N-cyclopropyl-N-(pyridin-3-ylmethyl)butanamide
CID 54869888
4-[cyclopropyl(pyridin-3-ylmethyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497568
N-[2-[cyclopropyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]-1H-indole-2-carboxamide
CID 71995258
N-cyclopropyl-2-(2-phenyl-1,3-thiazol-4-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 51207321
3-cyclopentyl-1-cyclopropyl-1-(pyridin-3-ylmethyl)urea
CID 71937848
N-cyclopropyl-2-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 46124380
2-anilino-N-cyclopropyl-N-(2-methylpropyl)acetamide
CID 60938792
N-(4-chlorophenyl)-N'-cyclopropyl-N'-(pyridin-3-ylmethyl)oxamide
CID 75493389

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide (CID 60937842) is 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide is O=C(CNc1ccccc1)N(Cc1cccnc1)C1CC1.
What is the InChIKey of 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is YXWQVNNSEVMFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(12-19-15-6-2-1-3-7-15)20(16-8-9-16)13-14-5-4-10-18-11-14/h1-7,10-11,16,19H,8-9,12-13H2.
What are the key properties of 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide?
2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-cyclopropyl-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 60937842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).